N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(4-propan-2-ylphenyl)ethanamide

Systemtic Name: N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(4-propan-2-ylphenyl)ethanamide Openeye Name: 2-(4-isopropylphenyl)-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-2-(4-propan-2-ylphenyl)acetamide IUPAC Name: N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-p-cumenyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC(=O)NC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC(=O)NC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S2/c1-14(2)16-10-8-15(9-11-16)12-19(26)22-20-23-24-21(28-20)27-13-18(25)17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H,22,23,26)